N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-0745 |
| Compound Name: | N-({1-[(3-fluorophenyl)methyl]piperidin-4-yl}methyl)-1,8-dimethyl-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 464.6 |
| Molecular Formula: | C26 H29 F N4 O S |
| Smiles: | Cc1ccc2c(c1)c1c(CS2)c(C(NCC2CCN(CC2)Cc2cccc(c2)F)=O)nn1C |
| Stereo: | ACHIRAL |
| logP: | 4.2903 |
| logD: | 2.367 |
| logSw: | -4.2892 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.707 |
| InChI Key: | BNECYTQXPPAVMQ-UHFFFAOYSA-N |